1-[[6-methyl-2,4-bis(oxidanylidene)pyran-3-ylidene]methyl]-3-phenethyl-thiourea

Systemtic Name: 1-[[6-methyl-2,4-bis(oxidanylidene)pyran-3-ylidene]methyl]-3-phenethyl-thiourea Openeye Name: 1-[(6-methyl-2,4-dioxo-pyran-3-ylidene)methyl]-3-phenethyl-thiourea CAS Name: 1-[(6-methyl-2,4-dioxo-3-pyranylidene)methyl]-3-phenethylthiourea IUPAC Name: 1-[(6-methyl-2,4-dioxopyran-3-ylidene)methyl]-3-phenethylthiourea Traditional Name: 1-[(2,4-diketo-6-methyl-pyran-3-ylidene)methyl]-3-phenethyl-thiourea Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=CNC(=S)NCCC2=CC=CC=C2)C(=O)O1

Isomeric SMILES

CC1=CC(=O)C(=CNC(=S)NCCC2=CC=CC=C2)C(=O)O1

InChI

InChI=1S/C16H16N2O3S/c1-11-9-14(19)13(15(20)21-11)10-18-16(22)17-8-7-12-5-3-2-4-6-12/h2-6,9-10H,7-8H2,1H3,(H2,17,18,22)