1-[[2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-3-pentyl-thiourea

Systemtic Name: 1-[[2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-3-pentyl-thiourea Openeye Name: 1-[[2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]-3-pentyl-thiourea CAS Name: 1-[[[2-(3-methoxypropyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]-3-pentylthiourea IUPAC Name: 1-[[2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carbonyl]amino]-3-pentylthiourea Traditional Name: 1-amyl-3-[[1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carbonyl]amino]thiourea Formula: C19H26N4O4S MolecularWeight: 406.49914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CCCOC

Isomeric SMILES

CCCCCNC(=S)NNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CCCOC

InChI

InChI=1S/C19H26N4O4S/c1-3-4-5-9-20-19(28)22-21-16(24)13-7-8-14-15(12-13)18(26)23(17(14)25)10-6-11-27-2/h7-8,12H,3-6,9-11H2,1-2H3,(H,21,24)(H2,20,22,28)