tert-butyl 2-[(4-dimethylaminophenyl)-[2-[(3-methylthiophen-2-yl)carbamoylamino]ethanoyl]amino]ethanoate

Systemtic Name: tert-butyl 2-[(4-dimethylaminophenyl)-[2-[(3-methylthiophen-2-yl)carbamoylamino]ethanoyl]amino]ethanoate Openeye Name: tert-butyl 2-[4-(dimethylamino)-N-[2-[(3-methyl-2-thienyl)carbamoylamino]acetyl]anilino]acetate CAS Name: 2-[4-(dimethylamino)-N-[2-[[[(3-methyl-2-thiophenyl)amino]-oxomethyl]amino]-1-oxoethyl]anilino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(dimethylamino)-N-[2-[(3-methylthiophen-2-yl)carbamoylamino]acetyl]anilino]acetate Traditional Name: 2-[4-(dimethylamino)-N-[2-[(3-methyl-2-thienyl)carbamoylamino]acetyl]anilino]acetic acid tert-butyl ester Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)NC(=O)NCC(=O)N(CC(=O)OC(C)(C)C)C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC1=C(SC=C1)NC(=O)NCC(=O)N(CC(=O)OC(C)(C)C)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C22H30N4O4S/c1-15-11-12-31-20(15)24-21(29)23-13-18(27)26(14-19(28)30-22(2,3)4)17-9-7-16(8-10-17)25(5)6/h7-12H,13-14H2,1-6H3,(H2,23,24,29)