1-[(4-methylthiophen-2-yl)-naphthalen-1-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(4-methylthiophen-2-yl)-naphthalen-1-yl-methyl]-1,4-diazepane Openeye Name: 1-[(4-methyl-2-thienyl)-(1-naphthyl)methyl]-1,4-diazepane CAS Name: 1-[(4-methyl-2-thiophenyl)-(1-naphthalenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-methylthiophen-2-yl)-naphthalen-1-ylmethyl]-1,4-diazepane Traditional Name: 1-[(4-methyl-2-thienyl)-(1-naphthyl)methyl]-1,4-diazepane Formula: C21H24N2S MolecularWeight: 336.49366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCNCC4

Isomeric SMILES

CC1=CSC(=C1)C(C2=CC=CC3=CC=CC=C32)N4CCCNCC4

InChI

InChI=1S/C21H24N2S/c1-16-14-20(24-15-16)21(23-12-5-10-22-11-13-23)19-9-4-7-17-6-2-3-8-18(17)19/h2-4,6-9,14-15,21-22H,5,10-13H2,1H3