N-[4-(dimethylamino)-3-(1-methyl-1,2,3,4-tetrazol-5-yl)phenyl]butanethioamide

Systemtic Name: N-[4-(dimethylamino)-3-(1-methyl-1,2,3,4-tetrazol-5-yl)phenyl]butanethioamide Openeye Name: N-[4-(dimethylamino)-3-(1-methyltetrazol-5-yl)phenyl]butanethioamide CAS Name: N-[4-(dimethylamino)-3-(1-methyl-5-tetrazolyl)phenyl]butanethioamide IUPAC Name: N-[4-(dimethylamino)-3-(1-methyltetrazol-5-yl)phenyl]butanethioamide Traditional Name: N-[4-(dimethylamino)-3-(1-methyltetrazol-5-yl)phenyl]thiobutyramide Formula: C14H20N6S MolecularWeight: 304.4138

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=S)NC1=CC(=C(C=C1)N(C)C)C2=NN=NN2C

Isomeric SMILES

CCCC(=S)NC1=CC(=C(C=C1)N(C)C)C2=NN=NN2C

InChI

InChI=1S/C14H20N6S/c1-5-6-13(21)15-10-7-8-12(19(2)3)11(9-10)14-16-17-18-20(14)4/h7-9H,5-6H2,1-4H3,(H,15,21)