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

Systemtic Name: 1-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[(2-allyl-1,3-dioxo-isoindoline-5-carbonyl)amino]-3-isopentyl-thiourea CAS Name: 1-[[(1,3-dioxo-2-prop-2-enyl-5-isoindolyl)-oxomethyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[(1,3-dioxo-2-prop-2-enylisoindole-5-carbonyl)amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[(2-allyl-1,3-diketo-isoindoline-5-carbonyl)amino]-3-isoamyl-thiourea Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC=C

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC=C

InChI

InChI=1S/C18H22N4O3S/c1-4-9-22-16(24)13-6-5-12(10-14(13)17(22)25)15(23)20-21-18(26)19-8-7-11(2)3/h4-6,10-11H,1,7-9H2,2-3H3,(H,20,23)(H2,19,21,26)