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

Systemtic Name: 1-[[(2R)-2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoyl]amino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[[(2R)-2-(4-methyl-2-oxo-chromen-7-yl)oxypropanoyl]amino]thiourea CAS Name: 1-[[(2R)-2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[[(2R)-2-(4-methyl-2-oxochromen-7-yl)oxypropanoyl]amino]thiourea Traditional Name: 1-benzyl-3-[[(2R)-2-(2-keto-4-methyl-chromen-7-yl)oxypropanoyl]amino]thiourea Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C(=O)NNC(=S)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)O[C@H](C)C(=O)NNC(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O4S/c1-13-10-19(25)28-18-11-16(8-9-17(13)18)27-14(2)20(26)23-24-21(29)22-12-15-6-4-3-5-7-15/h3-11,14H,12H2,1-2H3,(H,23,26)(H2,22,24,29)/t14-/m1/s1