N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(dimethylaminomethyl)quinazolin-4-amine

Systemtic Name: N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-(dimethylaminomethyl)quinazolin-4-amine Openeye Name: N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-(dimethylaminomethyl)quinazolin-4-amine CAS Name: N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-2-(dimethylaminomethyl)-4-quinazolinamine IUPAC Name: N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-2-(dimethylaminomethyl)quinazolin-4-amine Traditional Name: [4-(2-chloro-5-morpholinosulfonyl-anilino)quinazolin-2-yl]methyl-dimethyl-amine Formula: C21H24ClN5O3S MolecularWeight: 461.96496

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC2=CC=CC=C2C(=N1)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

Isomeric SMILES

CN(C)CC1=NC2=CC=CC=C2C(=N1)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

InChI

InChI=1S/C21H24ClN5O3S/c1-26(2)14-20-23-18-6-4-3-5-16(18)21(25-20)24-19-13-15(7-8-17(19)22)31(28,29)27-9-11-30-12-10-27/h3-8,13H,9-12,14H2,1-2H3,(H,23,24,25)