1-(4-methyl-2-oxidanylidene-chromen-7-yl)-3-(4-pyrrolidin-1-ylcarbonylphenyl)thiourea

Systemtic Name: 1-(4-methyl-2-oxidanylidene-chromen-7-yl)-3-(4-pyrrolidin-1-ylcarbonylphenyl)thiourea Openeye Name: 1-(4-methyl-2-oxo-chromen-7-yl)-3-[4-(pyrrolidine-1-carbonyl)phenyl]thiourea CAS Name: 1-(4-methyl-2-oxo-1-benzopyran-7-yl)-3-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]thiourea IUPAC Name: 1-(4-methyl-2-oxochromen-7-yl)-3-[4-(pyrrolidine-1-carbonyl)phenyl]thiourea Traditional Name: 1-(2-keto-4-methyl-chromen-7-yl)-3-[4-(pyrrolidine-1-carbonyl)phenyl]thiourea Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C22H21N3O3S/c1-14-12-20(26)28-19-13-17(8-9-18(14)19)24-22(29)23-16-6-4-15(5-7-16)21(27)25-10-2-3-11-25/h4-9,12-13H,2-3,10-11H2,1H3,(H2,23,24,29)