N-cyclooctyl-4-(thiophen-3-ylmethyl)-1,4-diazepane-1-carbothioamide

Systemtic Name: N-cyclooctyl-4-(thiophen-3-ylmethyl)-1,4-diazepane-1-carbothioamide Openeye Name: N-cyclooctyl-4-(3-thienylmethyl)-1,4-diazepane-1-carbothioamide CAS Name: N-cyclooctyl-4-(3-thiophenylmethyl)-1,4-diazepane-1-carbothioamide IUPAC Name: N-cyclooctyl-4-(thiophen-3-ylmethyl)-1,4-diazepane-1-carbothioamide Traditional Name: N-cyclooctyl-4-(3-thenyl)-1,4-diazepane-1-carbothioamide Formula: C19H31N3S2 MolecularWeight: 365.59954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=S)N2CCCN(CC2)CC3=CSC=C3

Isomeric SMILES

C1CCCC(CCC1)NC(=S)N2CCCN(CC2)CC3=CSC=C3

InChI

InChI=1S/C19H31N3S2/c23-19(20-18-7-4-2-1-3-5-8-18)22-11-6-10-21(12-13-22)15-17-9-14-24-16-17/h9,14,16,18H,1-8,10-13,15H2,(H,20,23)