1-[2-cyano-2-(4-methylphenyl)sulfonyl-ethenyl]-3-[(2-oxidanylideneindol-3-yl)amino]thiourea

Systemtic Name: 1-[2-cyano-2-(4-methylphenyl)sulfonyl-ethenyl]-3-[(2-oxidanylideneindol-3-yl)amino]thiourea Openeye Name: 1-[2-cyano-2-(p-tolylsulfonyl)vinyl]-3-[(2-oxoindol-3-yl)amino]thiourea CAS Name: 1-[2-cyano-2-(4-methylphenyl)sulfonylethenyl]-3-[(2-oxo-3-indolyl)amino]thiourea IUPAC Name: 1-[2-cyano-2-(4-methylphenyl)sulfonylethenyl]-3-[(2-oxoindol-3-yl)amino]thiourea Traditional Name: 1-(2-cyano-2-tosyl-vinyl)-3-[(2-ketoindol-3-yl)amino]thiourea Formula: C19H15N5O3S2 MolecularWeight: 425.4841

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CNC(=S)NNC2=C3C=CC=CC3=NC2=O)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(=CNC(=S)NNC2=C3C=CC=CC3=NC2=O)C#N

InChI

InChI=1S/C19H15N5O3S2/c1-12-6-8-13(9-7-12)29(26,27)14(10-20)11-21-19(28)24-23-17-15-4-2-3-5-16(15)22-18(17)25/h2-9,11H,1H3,(H2,21,24,28)(H,22,23,25)