1-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanone

Systemtic Name: 1-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanone Openeye Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-[5-(2-thienyl)tetrazol-2-yl]ethanone CAS Name: 1-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-(5-thiophen-2-yl-2-tetrazolyl)ethanone IUPAC Name: 1-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-2-(5-thiophen-2-yltetrazol-2-yl)ethanone Traditional Name: 1-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-[5-(2-thienyl)tetrazol-2-yl]ethanone Formula: C16H17N5OS MolecularWeight: 327.40408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)CN2N=C(N=N2)C3=CC=CS3

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)CN2N=C(N=N2)C3=CC=CS3

InChI

InChI=1S/C16H17N5OS/c1-4-7-20-11(2)9-13(12(20)3)14(22)10-21-18-16(17-19-21)15-6-5-8-23-15/h4-6,8-9H,1,7,10H2,2-3H3