1-[1-[2-[(7-chloranylquinolin-4-yl)amino]ethyl]-5-methyl-2-oxidanylidene-3H-indol-3-yl]thiourea

Systemtic Name: 1-[1-[2-[(7-chloranylquinolin-4-yl)amino]ethyl]-5-methyl-2-oxidanylidene-3H-indol-3-yl]thiourea Openeye Name: [1-[2-[(7-chloro-4-quinolyl)amino]ethyl]-5-methyl-2-oxo-indolin-3-yl]thiourea CAS Name: [1-[2-[(7-chloro-4-quinolinyl)amino]ethyl]-5-methyl-2-oxo-3H-indol-3-yl]thiourea IUPAC Name: [1-[2-[(7-chloroquinolin-4-yl)amino]ethyl]-5-methyl-2-oxo-3H-indol-3-yl]thiourea Traditional Name: [1-[2-[(7-chloro-4-quinolyl)amino]ethyl]-2-keto-5-methyl-indolin-3-yl]thiourea Formula: C21H20ClN5OS MolecularWeight: 425.9344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2NC(=S)N)CCNC3=C4C=CC(=CC4=NC=C3)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C2NC(=S)N)CCNC3=C4C=CC(=CC4=NC=C3)Cl

InChI

InChI=1S/C21H20ClN5OS/c1-12-2-5-18-15(10-12)19(26-21(23)29)20(28)27(18)9-8-25-16-6-7-24-17-11-13(22)3-4-14(16)17/h2-7,10-11,19H,8-9H2,1H3,(H,24,25)(H3,23,26,29)