(2-phenylazanylphenyl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (2-phenylazanylphenyl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (2-anilinophenyl)-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (2-anilinophenyl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (2-anilinophenyl)-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (2-anilinophenyl)-[4-(2-thenyl)-1,4-diazepan-1-yl]methanone Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC=CC=C2NC3=CC=CC=C3)CC4=CC=CS4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC=CC=C2NC3=CC=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C23H25N3OS/c27-23(21-11-4-5-12-22(21)24-19-8-2-1-3-9-19)26-14-7-13-25(15-16-26)18-20-10-6-17-28-20/h1-6,8-12,17,24H,7,13-16,18H2