N-[bis(prop-2-enyl)carbamothioyl]-4-heptoxy-benzamide

Systemtic Name: N-[bis(prop-2-enyl)carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-(diallylcarbamothioyl)-4-heptoxy-benzamide CAS Name: N-[[bis(prop-2-enyl)amino]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[bis(prop-2-enyl)carbamothioyl]-4-heptoxybenzamide Traditional Name: N-(diallylthiocarbamoyl)-4-heptoxy-benzamide Formula: C21H30N2O2S MolecularWeight: 374.5401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)N(CC=C)CC=C

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)N(CC=C)CC=C

InChI

InChI=1S/C21H30N2O2S/c1-4-7-8-9-10-17-25-19-13-11-18(12-14-19)20(24)22-21(26)23(15-5-2)16-6-3/h5-6,11-14H,2-4,7-10,15-17H2,1H3,(H,22,24,26)