1-(2-methylphenyl)-3-[(E)-(5-morpholin-4-ylsulfonyl-2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene)amino]thiourea

Systemtic Name: 1-(2-methylphenyl)-3-[(E)-(5-morpholin-4-ylsulfonyl-2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene)amino]thiourea Openeye Name: 1-[(E)-(1-allyl-5-morpholinosulfonyl-2-oxo-indolin-3-ylidene)amino]-3-(o-tolyl)thiourea CAS Name: 1-(2-methylphenyl)-3-[(E)-[5-(4-morpholinylsulfonyl)-2-oxo-1-prop-2-enyl-3-indolylidene]amino]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[(E)-(5-morpholin-4-ylsulfonyl-2-oxo-1-prop-2-enylindol-3-ylidene)amino]thiourea Traditional Name: 1-[(E)-(1-allyl-2-keto-5-morpholinosulfonyl-indolin-3-ylidene)amino]-3-(o-tolyl)thiourea Formula: C23H25N5O4S2 MolecularWeight: 499.6057

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NN=C2C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N(C2=O)CC=C

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N/N=C/2\C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)N(C2=O)CC=C

InChI

InChI=1S/C23H25N5O4S2/c1-3-10-28-20-9-8-17(34(30,31)27-11-13-32-14-12-27)15-18(20)21(22(28)29)25-26-23(33)24-19-7-5-4-6-16(19)2/h3-9,15H,1,10-14H2,2H3,(H2,24,26,33)/b25-21+