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

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl N'-propylcarbamimidothioate Openeye Name: 2-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl]-3-propyl-isothiourea CAS Name: N'-propylcarbamimidothioic 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'-propylcarbamimidothioate Traditional Name: 2-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl]-3-propyl-isothiourea Formula: C18H24N2O2S MolecularWeight: 332.46036

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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C(N)SCC1=CC(=O)OC2=CC(=C(C=C12)C(C)C)C

Isomeric SMILES

CCCN=C(N)SCC1=CC(=O)OC2=CC(=C(C=C12)C(C)C)C

InChI

InChI=1S/C18H24N2O2S/c1-5-6-20-18(19)23-10-13-8-17(21)22-16-7-12(4)14(11(2)3)9-15(13)16/h7-9,11H,5-6,10H2,1-4H3,(H2,19,20)