1-[(2-methylindol-3-ylidene)methylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea

Systemtic Name: 1-[(2-methylindol-3-ylidene)methylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Openeye Name: 1-[(2-methylindol-3-ylidene)methylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea CAS Name: 1-[(2-methyl-3-indolylidene)methylamino]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea IUPAC Name: 1-[(2-methylindol-3-ylidene)methylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Traditional Name: 1-[(2-methylindol-3-ylidene)methylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea Formula: C18H26N5OS+ MolecularWeight: 360.49694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C1=CNNC(=S)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=NC2=CC=CC=C2C1=CNNC(=S)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C18H25N5OS/c1-14-16(15-5-2-3-6-17(15)21-14)13-20-22-18(25)19-7-4-8-23-9-11-24-12-10-23/h2-3,5-6,13,20H,4,7-12H2,1H3,(H2,19,22,25)/p+1