5-(azepan-1-yl)-4-phenyl-N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide

Systemtic Name: 5-(azepan-1-yl)-4-phenyl-N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide Openeye Name: 5-(azepan-1-yl)-4-phenyl-N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide CAS Name: 5-(1-azepanyl)-4-phenyl-N-[2-(1-pyrrolidinyl)ethyl]-2-thiophenecarboxamide IUPAC Name: 5-(azepan-1-yl)-4-phenyl-N-(2-pyrrolidin-1-ylethyl)thiophene-2-carboxamide Traditional Name: 5-(azepan-1-yl)-4-phenyl-N-(2-pyrrolidinoethyl)thiophene-2-carboxamide Formula: C23H31N3OS MolecularWeight: 397.57674

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(S2)C(=O)NCCN3CCCC3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(S2)C(=O)NCCN3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C23H31N3OS/c27-22(24-12-17-25-13-8-9-14-25)21-18-20(19-10-4-3-5-11-19)23(28-21)26-15-6-1-2-7-16-26/h3-5,10-11,18H,1-2,6-9,12-17H2,(H,24,27)