N-[2-(cyclohexen-1-yl)ethyl]-4-(thiophen-3-ylmethyl)-1,4-diazepane-1-carbothioamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-4-(thiophen-3-ylmethyl)-1,4-diazepane-1-carbothioamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-4-(3-thienylmethyl)-1,4-diazepane-1-carbothioamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-4-(3-thiophenylmethyl)-1,4-diazepane-1-carbothioamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-4-(thiophen-3-ylmethyl)-1,4-diazepane-1-carbothioamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-4-(3-thenyl)-1,4-diazepane-1-carbothioamide Formula: C19H29N3S2 MolecularWeight: 363.58366

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=S)N2CCCN(CC2)CC3=CSC=C3

Isomeric SMILES

C1CCC(=CC1)CCNC(=S)N2CCCN(CC2)CC3=CSC=C3

InChI

InChI=1S/C19H29N3S2/c23-19(20-9-7-17-5-2-1-3-6-17)22-11-4-10-21(12-13-22)15-18-8-14-24-16-18/h5,8,14,16H,1-4,6-7,9-13,15H2,(H,20,23)