naphthalen-1-yl-[1-(thiophen-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone

Systemtic Name: naphthalen-1-yl-[1-(thiophen-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone Openeye Name: 1-naphthyl-[1-(3-thienylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone CAS Name: 1-naphthalenyl-[1-(3-thiophenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone IUPAC Name: naphthalen-1-yl-[1-(thiophen-3-ylmethyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone Traditional Name: 1-naphthyl-[1-(3-thenyl)-3,5-dihydro-2H-1,4-benzodiazepin-4-yl]methanone Formula: C25H22N2OS MolecularWeight: 398.51998

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2CN1C(=O)C3=CC=CC4=CC=CC=C43)CC5=CSC=C5

Isomeric SMILES

C1CN(C2=CC=CC=C2CN1C(=O)C3=CC=CC4=CC=CC=C43)CC5=CSC=C5

InChI

InChI=1S/C25H22N2OS/c28-25(23-10-5-8-20-6-1-3-9-22(20)23)27-14-13-26(16-19-12-15-29-18-19)24-11-4-2-7-21(24)17-27/h1-12,15,18H,13-14,16-17H2