(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl N'-(phenylmethyl)carbamimidothioate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl N'-(phenylmethyl)carbamimidothioate Openeye Name: 3-benzyl-2-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl]isothiourea CAS Name: N'-(phenylmethyl)carbamimidothioic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl N'-benzylcarbamimidothioate Traditional Name: 3-benzyl-2-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl]isothiourea Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC(=NCC3=CC=CC=C3)N)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC(=NCC3=CC=CC=C3)N)C(C)C

InChI

InChI=1S/C22H24N2O2S/c1-14(2)18-11-19-17(10-21(25)26-20(19)9-15(18)3)13-27-22(23)24-12-16-7-5-4-6-8-16/h4-11,14H,12-13H2,1-3H3,(H2,23,24)