1-[2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoylamino]-3-cyclopentyl-thiourea

Systemtic Name: 1-[2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoylamino]-3-cyclopentyl-thiourea Openeye Name: 1-cyclopentyl-3-[[2-(1,3-dioxo-4H-isoquinolin-2-yl)acetyl]amino]thiourea CAS Name: 1-cyclopentyl-3-[[2-(1,3-dioxo-4H-isoquinolin-2-yl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-cyclopentyl-3-[[2-(1,3-dioxo-4H-isoquinolin-2-yl)acetyl]amino]thiourea Traditional Name: 1-cyclopentyl-3-[[2-(1,3-diketo-4H-isoquinolin-2-yl)acetyl]amino]thiourea Formula: C17H20N4O3S MolecularWeight: 360.4307

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=S)NNC(=O)CN2C(=O)CC3=CC=CC=C3C2=O

Isomeric SMILES

C1CCC(C1)NC(=S)NNC(=O)CN2C(=O)CC3=CC=CC=C3C2=O

InChI

InChI=1S/C17H20N4O3S/c22-14(19-20-17(25)18-12-6-2-3-7-12)10-21-15(23)9-11-5-1-4-8-13(11)16(21)24/h1,4-5,8,12H,2-3,6-7,9-10H2,(H,19,22)(H2,18,20,25)