1-butyl-3-[[(2S)-2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]thiourea

Systemtic Name: 1-butyl-3-[[(2S)-2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]thiourea Openeye Name: 1-butyl-3-[[(2S)-2-(4-methyl-2-oxo-chromen-7-yl)oxypropanoyl]amino]thiourea CAS Name: 1-butyl-3-[[(2S)-2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]thiourea IUPAC Name: 1-butyl-3-[[(2S)-2-(4-methyl-2-oxochromen-7-yl)oxypropanoyl]amino]thiourea Traditional Name: 1-butyl-3-[[(2S)-2-(2-keto-4-methyl-chromen-7-yl)oxypropanoyl]amino]thiourea Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=O)C(C)OC1=CC2=C(C=C1)C(=CC(=O)O2)C

Isomeric SMILES

CCCCNC(=S)NNC(=O)[C@H](C)OC1=CC2=C(C=C1)C(=CC(=O)O2)C

InChI

InChI=1S/C18H23N3O4S/c1-4-5-8-19-18(26)21-20-17(23)12(3)24-13-6-7-14-11(2)9-16(22)25-15(14)10-13/h6-7,9-10,12H,4-5,8H2,1-3H3,(H,20,23)(H2,19,21,26)/t12-/m0/s1