1-[(E)-(2-chloranyl-1-pentanoyl-indol-3-yl)methylideneamino]thiourea

Systemtic Name: 1-[(E)-(2-chloranyl-1-pentanoyl-indol-3-yl)methylideneamino]thiourea Openeye Name: [(E)-(2-chloro-1-pentanoyl-indol-3-yl)methyleneamino]thiourea CAS Name: [(E)-[2-chloro-1-(1-oxopentyl)-3-indolyl]methylideneamino]thiourea IUPAC Name: [(E)-(2-chloro-1-pentanoylindol-3-yl)methylideneamino]thiourea Traditional Name: [(E)-(2-chloro-1-valeryl-indol-3-yl)methyleneamino]thiourea Formula: C15H17ClN4OS MolecularWeight: 336.83968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1C2=CC=CC=C2C(=C1Cl)C=NNC(=S)N

Isomeric SMILES

CCCCC(=O)N1C2=CC=CC=C2C(=C1Cl)/C=N/NC(=S)N

InChI

InChI=1S/C15H17ClN4OS/c1-2-3-8-13(21)20-12-7-5-4-6-10(12)11(14(20)16)9-18-19-15(17)22/h4-7,9H,2-3,8H2,1H3,(H3,17,19,22)/b18-9+