1-(3-chloranyl-4-methyl-phenyl)-3-[[5-(4-methylpiperidin-1-yl)sulfonyl-2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene]amino]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[[5-(4-methylpiperidin-1-yl)sulfonyl-2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene]amino]thiourea Openeye Name: 1-[[1-allyl-5-[(4-methyl-1-piperidyl)sulfonyl]-2-oxo-indolin-3-ylidene]amino]-3-(3-chloro-4-methyl-phenyl)thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[[5-[(4-methyl-1-piperidinyl)sulfonyl]-2-oxo-1-prop-2-enyl-3-indolylidene]amino]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[[5-(4-methylpiperidin-1-yl)sulfonyl-2-oxo-1-prop-2-enylindol-3-ylidene]amino]thiourea Traditional Name: 1-[[1-allyl-2-keto-5-(4-methylpiperidino)sulfonyl-indolin-3-ylidene]amino]-3-(3-chloro-4-methyl-phenyl)thiourea Formula: C25H28ClN5O3S2 MolecularWeight: 546.10452

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=NNC(=S)NC4=CC(=C(C=C4)C)Cl)CC=C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3=NNC(=S)NC4=CC(=C(C=C4)C)Cl)CC=C

InChI

InChI=1S/C25H28ClN5O3S2/c1-4-11-31-22-8-7-19(36(33,34)30-12-9-16(2)10-13-30)15-20(22)23(24(31)32)28-29-25(35)27-18-6-5-17(3)21(26)14-18/h4-8,14-16H,1,9-13H2,2-3H3,(H2,27,29,35)