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

Systemtic Name: [4-(4-aminophenyl)-1,4-diazepan-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-(4-aminophenyl)-1,4-diazepan-1-yl]-(2-thienyl)methanone CAS Name: [4-(4-aminophenyl)-1,4-diazepan-1-yl]-thiophen-2-ylmethanone IUPAC Name: [4-(4-aminophenyl)-1,4-diazepan-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-(4-aminophenyl)-1,4-diazepan-1-yl]-(2-thienyl)methanone Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC=CS2)C3=CC=C(C=C3)N

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC=CS2)C3=CC=C(C=C3)N

InChI

InChI=1S/C16H19N3OS/c17-13-4-6-14(7-5-13)18-8-2-9-19(11-10-18)16(20)15-3-1-12-21-15/h1,3-7,12H,2,8-11,17H2