1-[(E)-[3-methyl-2-(2-methylpiperidin-1-yl)carbonyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-[3-methyl-2-(2-methylpiperidin-1-yl)carbonyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-3-phenyl-thiourea Openeye Name: 1-[(E)-[3-methyl-2-(2-methylpiperidine-1-carbonyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-phenyl-thiourea CAS Name: 1-[(E)-[3-methyl-2-[(2-methyl-1-piperidinyl)-oxomethyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-phenylthiourea IUPAC Name: 1-[(E)-[3-methyl-2-(2-methylpiperidine-1-carbonyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-3-phenylthiourea Traditional Name: 1-[(E)-[3-methyl-2-(2-methylpiperidine-1-carbonyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-3-phenyl-thiourea Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=C(C3=C(O2)CCCC3=NNC(=S)NC4=CC=CC=C4)C

Isomeric SMILES

CC1CCCCN1C(=O)C2=C(C\3=C(O2)CCC/C3=N\NC(=S)NC4=CC=CC=C4)C

InChI

InChI=1S/C23H28N4O2S/c1-15-9-6-7-14-27(15)22(28)21-16(2)20-18(12-8-13-19(20)29-21)25-26-23(30)24-17-10-4-3-5-11-17/h3-5,10-11,15H,6-9,12-14H2,1-2H3,(H2,24,26,30)/b25-18+