N-[2-oxidanylidene-4-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]chromen-7-yl]ethanamide

Systemtic Name: N-[2-oxidanylidene-4-[(1-propan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]chromen-7-yl]ethanamide Openeye Name: N-[4-[(1-isopropyltetrazol-5-yl)sulfanylmethyl]-2-oxo-chromen-7-yl]acetamide CAS Name: N-[2-oxo-4-[[(1-propan-2-yl-5-tetrazolyl)thio]methyl]-1-benzopyran-7-yl]acetamide IUPAC Name: N-[2-oxo-4-[(1-propan-2-yltetrazol-5-yl)sulfanylmethyl]chromen-7-yl]acetamide Traditional Name: N-[4-[[(1-isopropyltetrazol-5-yl)thio]methyl]-2-keto-chromen-7-yl]acetamide Formula: C16H17N5O3S MolecularWeight: 359.40288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=N1)SCC2=CC(=O)OC3=C2C=CC(=C3)NC(=O)C

Isomeric SMILES

CC(C)N1C(=NN=N1)SCC2=CC(=O)OC3=C2C=CC(=C3)NC(=O)C

InChI

InChI=1S/C16H17N5O3S/c1-9(2)21-16(18-19-20-21)25-8-11-6-15(23)24-14-7-12(17-10(3)22)4-5-13(11)14/h4-7,9H,8H2,1-3H3,(H,17,22)