(4-fluoranylnaphthalen-1-yl)-[4-(thiophen-3-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (4-fluoranylnaphthalen-1-yl)-[4-(thiophen-3-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-fluoro-1-naphthyl)-[4-(3-thienylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (4-fluoro-1-naphthalenyl)-[4-(3-thiophenylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-fluoronaphthalen-1-yl)-[4-(thiophen-3-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (4-fluoro-1-naphthyl)-[4-(3-thenyl)-1,4-diazepan-1-yl]methanone Formula: C21H21FN2OS MolecularWeight: 368.467643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC=C(C3=CC=CC=C32)F)CC4=CSC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC=C(C3=CC=CC=C32)F)CC4=CSC=C4

InChI

InChI=1S/C21H21FN2OS/c22-20-7-6-19(17-4-1-2-5-18(17)20)21(25)24-10-3-9-23(11-12-24)14-16-8-13-26-15-16/h1-2,4-8,13,15H,3,9-12,14H2