1-(2-methylpropyl)-4-(2-phenylsulfanylethyl)-1,4-diazepan-5-one

Systemtic Name: 1-(2-methylpropyl)-4-(2-phenylsulfanylethyl)-1,4-diazepan-5-one Openeye Name: 1-isobutyl-4-(2-phenylsulfanylethyl)-1,4-diazepan-5-one CAS Name: 1-(2-methylpropyl)-4-[2-(phenylthio)ethyl]-1,4-diazepan-5-one IUPAC Name: 1-(2-methylpropyl)-4-(2-phenylsulfanylethyl)-1,4-diazepan-5-one Traditional Name: 1-isobutyl-4-[2-(phenylthio)ethyl]-1,4-diazepan-5-one Formula: C17H26N2OS MolecularWeight: 306.46614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCC(=O)N(CC1)CCSC2=CC=CC=C2

Isomeric SMILES

CC(C)CN1CCC(=O)N(CC1)CCSC2=CC=CC=C2

InChI

InChI=1S/C17H26N2OS/c1-15(2)14-18-9-8-17(20)19(11-10-18)12-13-21-16-6-4-3-5-7-16/h3-7,15H,8-14H2,1-2H3