N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-2-(phenylsulfonylamino)ethanamide

Systemtic Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-2-(phenylsulfonylamino)ethanamide Openeye Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methyleneamino]-2-(benzenesulfonamido)acetamide CAS Name: N-[(Z)-[4-(1-azepanyl)phenyl]methylideneamino]-2-(benzenesulfonamido)acetamide IUPAC Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-2-(benzenesulfonamido)acetamide Traditional Name: N-[(Z)-[4-(azepan-1-yl)benzylidene]amino]-2-(benzenesulfonamido)acetamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)C=NNC(=O)CNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)/C=N\NC(=O)CNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N4O3S/c26-21(17-23-29(27,28)20-8-4-3-5-9-20)24-22-16-18-10-12-19(13-11-18)25-14-6-1-2-7-15-25/h3-5,8-13,16,23H,1-2,6-7,14-15,17H2,(H,24,26)/b22-16-