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

Systemtic Name: 1-[(E)-(3-methyl-2-pyrrolidin-1-ylcarbonyl-6,7-dihydro-5H-1-benzofuran-4-ylidene)amino]thiourea Openeye Name: [(E)-[3-methyl-2-(pyrrolidine-1-carbonyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]thiourea CAS Name: [(E)-[3-methyl-2-[oxo(1-pyrrolidinyl)methyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]thiourea IUPAC Name: [(E)-[3-methyl-2-(pyrrolidine-1-carbonyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]thiourea Traditional Name: [(E)-[3-methyl-2-(pyrrolidine-1-carbonyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]thiourea Formula: C15H20N4O2S MolecularWeight: 320.4099

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=S)N)CCC2)C(=O)N3CCCC3

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=S)N)/CCC2)C(=O)N3CCCC3

InChI

InChI=1S/C15H20N4O2S/c1-9-12-10(17-18-15(16)22)5-4-6-11(12)21-13(9)14(20)19-7-2-3-8-19/h2-8H2,1H3,(H3,16,18,22)/b17-10+