N-[2-(2-pyrrolidin-1-ylethoxy)ethyl]-4-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)benzamide

Systemtic Name: N-[2-(2-pyrrolidin-1-ylethoxy)ethyl]-4-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)benzamide Openeye Name: N-[2-(2-pyrrolidin-1-ylethoxy)ethyl]-4-(5-thioxo-2H-tetrazol-1-yl)benzamide CAS Name: N-[2-[2-(1-pyrrolidinyl)ethoxy]ethyl]-4-(5-sulfanylidene-2H-tetrazol-1-yl)benzamide IUPAC Name: N-[2-(2-pyrrolidin-1-ylethoxy)ethyl]-4-(5-sulfanylidene-2H-tetrazol-1-yl)benzamide Traditional Name: N-[2-(2-pyrrolidinoethoxy)ethyl]-4-(5-thioxo-2H-tetrazol-1-yl)benzamide Formula: C16H22N6O2S MolecularWeight: 362.44988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOCCNC(=O)C2=CC=C(C=C2)N3C(=S)N=NN3

Isomeric SMILES

C1CCN(C1)CCOCCNC(=O)C2=CC=C(C=C2)N3C(=S)N=NN3

InChI

InChI=1S/C16H22N6O2S/c23-15(17-7-11-24-12-10-21-8-1-2-9-21)13-3-5-14(6-4-13)22-16(25)18-19-20-22/h3-6H,1-2,7-12H2,(H,17,23)(H,18,20,25)