1-[2-(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[2-(7-methoxy-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[2-(7-methoxy-2-oxo-1H-quinolin-3-yl)ethyl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[2-(2-keto-7-methoxy-1H-quinolin-3-yl)ethyl]-3-(4-nitrophenyl)thiourea Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C(=O)N2)CCNC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O4S/c1-27-16-7-2-12-10-13(18(24)22-17(12)11-16)8-9-20-19(28)21-14-3-5-15(6-4-14)23(25)26/h2-7,10-11H,8-9H2,1H3,(H,22,24)(H2,20,21,28)