1-[(E)-[2-(3,4-dihydro-2H-quinolin-1-ylcarbonyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]thiourea

Systemtic Name: 1-[(E)-[2-(3,4-dihydro-2H-quinolin-1-ylcarbonyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]thiourea Openeye Name: [(E)-[2-(3,4-dihydro-2H-quinoline-1-carbonyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]thiourea CAS Name: [(E)-[2-[3,4-dihydro-2H-quinolin-1-yl(oxo)methyl]-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]thiourea IUPAC Name: [(E)-[2-(3,4-dihydro-2H-quinoline-1-carbonyl)-3-methyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]thiourea Traditional Name: [(E)-[2-(3,4-dihydro-2H-quinoline-1-carbonyl)-3-methyl-6,7-dihydro-5H-benzofuran-4-ylidene]amino]thiourea Formula: C20H22N4O2S MolecularWeight: 382.47928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=S)N)CCC2)C(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=S)N)/CCC2)C(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C20H22N4O2S/c1-12-17-14(22-23-20(21)27)8-4-10-16(17)26-18(12)19(25)24-11-5-7-13-6-2-3-9-15(13)24/h2-3,6,9H,4-5,7-8,10-11H2,1H3,(H3,21,23,27)/b22-14+