1-(2,7-dimethyl-2-propyl-chromen-6-yl)-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-(2,7-dimethyl-2-propyl-chromen-6-yl)-3-(4-nitrophenyl)thiourea Openeye Name: 1-(2,7-dimethyl-2-propyl-chromen-6-yl)-3-(4-nitrophenyl)thiourea CAS Name: 1-(2,7-dimethyl-2-propyl-1-benzopyran-6-yl)-3-(4-nitrophenyl)thiourea IUPAC Name: 1-(2,7-dimethyl-2-propylchromen-6-yl)-3-(4-nitrophenyl)thiourea Traditional Name: 1-(2,7-dimethyl-2-propyl-chromen-6-yl)-3-(4-nitrophenyl)thiourea Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C=CC2=CC(=C(C=C2O1)C)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCCC1(C=CC2=CC(=C(C=C2O1)C)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H23N3O3S/c1-4-10-21(3)11-9-15-13-18(14(2)12-19(15)27-21)23-20(28)22-16-5-7-17(8-6-16)24(25)26/h5-9,11-13H,4,10H2,1-3H3,(H2,22,23,28)