N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[(4-keto-1H-quinazolin-2-yl)methyl-methyl-amino]acetamide Formula: C25H31N5O4S MolecularWeight: 497.60974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN(C)CC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN(C)CC2=NC(=O)C3=CC=CC=C3N2)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H31N5O4S/c1-18-11-12-19(15-22(18)35(33,34)30-13-7-3-4-8-14-30)26-24(31)17-29(2)16-23-27-21-10-6-5-9-20(21)25(32)28-23/h5-6,9-12,15H,3-4,7-8,13-14,16-17H2,1-2H3,(H,26,31)(H,27,28,32)