1-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]-3-(4-chlorophenyl)thiourea

Systemtic Name: 1-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]-3-(4-chlorophenyl)thiourea Openeye Name: 1-[(2-allyl-1,3-dioxo-isoindoline-5-carbonyl)amino]-3-(4-chlorophenyl)thiourea CAS Name: 1-(4-chlorophenyl)-3-[[(1,3-dioxo-2-prop-2-enyl-5-isoindolyl)-oxomethyl]amino]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[(1,3-dioxo-2-prop-2-enylisoindole-5-carbonyl)amino]thiourea Traditional Name: 1-[(2-allyl-1,3-diketo-isoindoline-5-carbonyl)amino]-3-(4-chlorophenyl)thiourea Formula: C19H15ClN4O3S MolecularWeight: 414.8654

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NNC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C=CCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NNC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H15ClN4O3S/c1-2-9-24-17(26)14-8-3-11(10-15(14)18(24)27)16(25)22-23-19(28)21-13-6-4-12(20)5-7-13/h2-8,10H,1,9H2,(H,22,25)(H2,21,23,28)