4-(azepan-1-yl)-2-phenyl-N-(phenylsulfonyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide

Systemtic Name: 4-(azepan-1-yl)-2-phenyl-N-(phenylsulfonyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Openeye Name: 4-(azepan-1-yl)-N-(benzenesulfonyl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide CAS Name: 4-(1-azepanyl)-N-(benzenesulfonyl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide IUPAC Name: 4-(azepan-1-yl)-N-(benzenesulfonyl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Traditional Name: 4-(azepan-1-yl)-N-besyl-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide Formula: C26H29N5O3S MolecularWeight: 491.60516

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC3=C2CN(CC3)C(=O)NS(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC3=C2CN(CC3)C(=O)NS(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H29N5O3S/c32-26(29-35(33,34)21-13-7-4-8-14-21)31-18-15-23-22(19-31)25(30-16-9-1-2-10-17-30)28-24(27-23)20-11-5-3-6-12-20/h3-8,11-14H,1-2,9-10,15-19H2,(H,29,32)