N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-1H-pyrrole-2-carboxamide

Systemtic Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-1H-pyrrole-2-carboxamide Openeye Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methyleneamino]-1H-pyrrole-2-carboxamide CAS Name: N-[(Z)-[4-(1-azepanyl)phenyl]methylideneamino]-1H-pyrrole-2-carboxamide IUPAC Name: N-[(Z)-[4-(azepan-1-yl)phenyl]methylideneamino]-1H-pyrrole-2-carboxamide Traditional Name: N-[(Z)-[4-(azepan-1-yl)benzylidene]amino]-1H-pyrrole-2-carboxamide Formula: C18H22N4O MolecularWeight: 310.39348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)C=NNC(=O)C3=CC=CN3

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)/C=N\NC(=O)C3=CC=CN3

InChI

InChI=1S/C18H22N4O/c23-18(17-6-5-11-19-17)21-20-14-15-7-9-16(10-8-15)22-12-3-1-2-4-13-22/h5-11,14,19H,1-4,12-13H2,(H,21,23)/b20-14-