tert-butyl N-[3-[2-(3,4-dichlorophenyl)ethanoyl-(2-dimethylaminoethyl)amino]-3-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-N-methyl-carbamate

Systemtic Name: tert-butyl N-[3-[2-(3,4-dichlorophenyl)ethanoyl-(2-dimethylaminoethyl)amino]-3-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]propyl]-N-methyl-carbamate Openeye Name: tert-butyl N-[3-[[2-(3,4-dichlorophenyl)acetyl]-(2-dimethylaminoethyl)amino]-3-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]propyl]-N-methyl-carbamate CAS Name: N-[3-[[2-(3,4-dichlorophenyl)-1-oxoethyl]-(2-dimethylaminoethyl)amino]-3-[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]propyl]-N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[[2-(3,4-dichlorophenyl)acetyl]-(2-dimethylaminoethyl)amino]-3-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]propyl]-N-methylcarbamate Traditional Name: N-[3-[[2-(3,4-dichlorophenyl)acetyl]-(2-dimethylaminoethyl)amino]-3-(4-keto-3-p-phenetyl-quinazolin-2-yl)propyl]-N-methyl-carbamic acid tert-butyl ester Formula: C37H45Cl2N5O5 MolecularWeight: 710.6897

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(CCN(C)C(=O)OC(C)(C)C)N(CCN(C)C)C(=O)CC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(CCN(C)C(=O)OC(C)(C)C)N(CCN(C)C)C(=O)CC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C37H45Cl2N5O5/c1-8-48-27-16-14-26(15-17-27)44-34(40-31-12-10-9-11-28(31)35(44)46)32(19-20-42(7)36(47)49-37(2,3)4)43(22-21-41(5)6)33(45)24-25-13-18-29(38)30(39)23-25/h9-18,23,32H,8,19-22,24H2,1-7H3